Information card for entry 4077176

Structure parameters

• Formula: C24 H36 Fe2 O12 Sn2
• Calculated formula: C24 H36 Fe2 O12 Sn2
• SMILES: CC(C)(C)[O]1[Sn]([Fe](C#[O])(C#[O])(C#[O])C#[O])([O](C(C)(C)C)[Sn]1(OC(C)(C)C)[Fe](C#[O])(C#[O])(C#[O])C#[O])OC(C)(C)C
• Title of publication: New Mono- and Polynuclear Iron Silylene and Stannylene Complexes
• Authors of publication: Braunstein, Pierre; Veith, Michael; Blin, Joël; Huch, Volker
• Journal of publication: Organometallics
• Year of publication: 2001
• Journal volume: 20
• Journal issue: 4
• Pages of publication: 627
• a: 8.996 ± 0.002 Å
• b: 11.638 ± 0.002 Å
• c: 16.057 ± 0.003 Å
• α: 90°
• β: 92.13 ± 0.03°
• γ: 90°
• Cell volume: 1679.9 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0341
• Residual factor for significantly intense reflections: 0.0281
• Weighted residual factors for significantly intense reflections: 0.0745
• Weighted residual factors for all reflections included in the refinement: 0.0799
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No